Methyl 2-Methyl-2-phenylpropanoate - CAS 57625-74-8

Catalog:	BB029774
Product Name:	Methyl 2-Methyl-2-phenylpropanoate
CAS:	57625-74-8
Synonyms:	2-methyl-2-phenylpropanoic acid methyl ester; methyl 2-methyl-2-phenylpropanoate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-methyl-2-phenylpropanoate
Description:	Methyl 2-Methyl-2-phenylpropanoate (CAS# 57625-74-8) is a compound useful in organic synthesis.
Molecular Weight:	178.23
Molecular Formula:	C11H14O2
Canonical SMILES:	CC(C)(C1=CC=CC=C1)C(=O)OC
InChI:	InChI=1S/C11H14O2/c1-11(2,10(12)13-3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChI Key:	WITYUUTUSPKOAB-UHFFFAOYSA-N
Boiling Point:	230.2 °C at 760 mmHg
Density:	1.012 g/cm³
LogP:	2.13720

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Complexity:	179
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.099379685
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	178.099379685
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6